aluminum; 4-(dimethylamino)benzoate; 4-(dodecylamino)-4-oxidanylidene-butanoic acid; propan-2-olate

Systemtic Name: aluminum; 4-(dimethylamino)benzoate; 4-(dodecylamino)-4-oxidanylidene-butanoic acid; propan-2-olate Openeye Name: aluminum; 4-(dimethylamino)benzoate; 4-(dodecylamino)-4-oxo-butanoic acid; propan-2-olate CAS Name: aluminum; 4-(dimethylamino)benzoate; 4-(dodecylamino)-4-oxobutanoic acid; 2-propanolate IUPAC Name: aluminum; 4-(dimethylamino)benzoate; 4-(dodecylamino)-4-oxobutanoic acid; propan-2-olate Traditional Name: aluminum; 4-(dimethylamino)benzoate; 4-keto-4-(laurylamino)butyric acid; propan-2-olate Formula: C34H62AlN2O8- MolecularWeight: 653.846218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(=O)CCC(=O)O.CC(C)[O-].CC(C)[O-].CC(C)[O-].CN(C)C1=CC=C(C=C1)C(=O)[O-].[Al+3]

Isomeric SMILES

CCCCCCCCCCCCNC(=O)CCC(=O)O.CC(C)[O-].CC(C)[O-].CC(C)[O-].CN(C)C1=CC=C(C=C1)C(=O)[O-].[Al+3]

InChI

InChI=1S/C16H31NO3.C9H11NO2.3C3H7O.Al/c1-2-3-4-5-6-7-8-9-10-11-14-17-15(18)12-13-16(19)20;1-10(2)8-5-3-7(4-6-8)9(11)12;3*1-3(2)4;/h2-14H2,1H3,(H,17,18)(H,19,20);3-6H,1-2H3,(H,11,12);3*3H,1-2H3;/q;;3*-1;+3/p-1